Vitas-M small molecule compound
6-methyl 3-[2-(propan-2-yloxy)ethyl] 4-(1,3-benzodioxol-5-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404971
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc3c(c1)OCO3)C(=C(N2)C)C(=O)OCCOC(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H31NO8 MW 485.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO8/c1-13(2)32-8-9-33-26(30)21-15(4)27-17-10-14(3)20(25(29)31-5)24(28)23(17)22(21)16-6-7-18-19(11-16)35-12-34-18/h6-7,11,13-14,20,22,27H,8-10,12H2,1-5H3InChIKey
PDRSTMYNXAPFRQ-UHFFFAOYSA-NSynonyms
6methyl3(2(propan2yloxy)ethyl)4(13benzodioxol5yl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3O(2propan2yloxyethyl)4(13benzodioxol5yl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCCOC(C)C)C3=CC4=C(C=C3)OCO4)C(=O)C1C(=O)OC
InChI=1SC26H31NO8c113(2)32893326(30)2115(4)27171014(3)20(25(29)315)24(28)23(17)22(21)16671819(1116)35123418h67111314202227H81012H215H3
MFCD05026930
ZINC000012319977
ZINC000239174028
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